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114626-46-9 | Benzenamine, N,N-dimethyl-4-[2-(2-methyl-1H-benzimidazol-6-yl)diazenyl]-
CAS No: 114626-46-9 Catalog No: AG000EV9 MDL No:
Product Description
Catalog Number:
AG000EV9
Chemical Name:
Benzenamine, N,N-dimethyl-4-[2-(2-methyl-1H-benzimidazol-6-yl)diazenyl]-
CAS Number:
114626-46-9
Molecular Formula:
C16H17N5
Molecular Weight:
279.3397
IUPAC Name:
N,N-dimethyl-4-[(2-methyl-3H-benzimidazol-5-yl)diazenyl]aniline
InChI:
InChI=1S/C16H17N5/c1-11-17-15-9-6-13(10-16(15)18-11)20-19-12-4-7-14(8-5-12)21(2)3/h4-10H,1-3H3,(H,17,18)
InChI Key:
CSFFMYZAHDNTBQ-UHFFFAOYSA-N
SMILES:
Cc1nc2c([nH]1)cc(cc2)N=Nc1ccc(cc1)N(C)C
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.148g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.347g/mol
Monoisotopic Mass:
279.148g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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